ethyl 2-[(2-azanylidene-8-oxidanyl-chromen-3-yl)carbonylamino]-4-(4-bromophenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(2-azanylidene-8-oxidanyl-chromen-3-yl)carbonylamino]-4-(4-bromophenyl)thiophene-3-carboxylate Openeye Name: ethyl 4-(4-bromophenyl)-2-[(8-hydroxy-2-imino-chromene-3-carbonyl)amino]thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-2-[[(8-hydroxy-2-imino-1-benzopyran-3-yl)-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-bromophenyl)-2-[(8-hydroxy-2-iminochromene-3-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-[(8-hydroxy-2-imino-chromene-3-carbonyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C23H17BrN2O5S MolecularWeight: 513.36048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)C3=CC4=C(C(=CC=C4)O)OC3=N

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)C3=CC4=C(C(=CC=C4)O)OC3=N

InChI

InChI=1S/C23H17BrN2O5S/c1-2-30-23(29)18-16(12-6-8-14(24)9-7-12)11-32-22(18)26-21(28)15-10-13-4-3-5-17(27)19(13)31-20(15)25/h3-11,25,27H,2H2,1H3,(H,26,28)